SCHEMBL2646771

SCHEMBL2646771

CS(=O)(=O)c1ccc(Oc2cc3nc(-c4ccccn4)[nH]c3cc2C2CCCN2C(=O)CC#N)cc1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.80

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2644449 0.92 GCK (0.85) GCK
SCHEMBL2644370 0.92 GCK (0.85) GCK
SCHEMBL2644498 0.90 GCK (0.81) GCK
SCHEMBL2646290 0.89 GCK (1.00) GCK
SCHEMBL2644372 0.89 GCK (0.80) GCK
SCHEMBL2643983 0.89 GCK (0.80) GCK
SCHEMBL2645446 0.89 GCK (0.87) GCK
SCHEMBL2645387 0.88 GCK (0.79) GCK
SCHEMBL2646347 0.88 GCK (0.79) GCK
SCHEMBL2645800 0.88 GCK (0.82) GCK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1702919-B1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE MSD KK (JP) 2012-05-30 EP disclosed
EP-1702919-A1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-09-20 EP disclosed